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13050-15-2 | 1,3-Dioxolane-2-undecanenitrile
CAS No: 13050-15-2 Catalog No: AG000UIM MDL No:
Product Description
Catalog Number:
AG000UIM
Chemical Name:
1,3-Dioxolane-2-undecanenitrile
CAS Number:
13050-15-2
Molecular Formula:
C14H25NO2
Molecular Weight:
239.3538
IUPAC Name:
11-(1,3-dioxolan-2-yl)undecanenitrile
InChI:
InChI=1S/C14H25NO2/c15-11-9-7-5-3-1-2-4-6-8-10-14-16-12-13-17-14/h14H,1-10,12-13H2
InChI Key:
DOXJQTXTZIWZLR-UHFFFAOYSA-N
SMILES:
N#CCCCCCCCCCCC1OCCO1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.189g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.359g/mol
Monoisotopic Mass:
239.189g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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